gold(1+);methanesulfonate;triphenylphosphane

C19H18AuO3PS — CID 172719682

IUPACgold(1+);methanesulfonate;triphenylphosphane
SMILESCS(=O)(=O)[O-].[Au+].c1ccc(P(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C18H15P.CH4O3S.Au/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-5(2,3)4;/h1-15H;1H3,(H,2,3,4);/q;;+1/p-1
InChIKeyGIKPMOYOPXMJBZ-UHFFFAOYSA-M
MW554.36 g/mol
LogP2.60
Rot. Bonds3

About gold(1+);methanesulfonate;triphenylphosphane

gold(1+);methanesulfonate;triphenylphosphane (PubChem CID 172719682) has the molecular formula C19H18AuO3PS and a molecular weight of 554.36 g/mol. Its IUPAC name is gold(1+);methanesulfonate;triphenylphosphane.

Molecular Properties

Compound Namegold(1+);methanesulfonate;triphenylphosphane
PubChem CID172719682
Molecular FormulaC19H18AuO3PS
Molecular Weight554.36 g/mol
Exact Mass554.04
IUPAC Namegold(1+);methanesulfonate;triphenylphosphane
SMILESCS(=O)(=O)[O-].[Au+].c1ccc(P(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C18H15P.CH4O3S.Au/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-5(2,3)4;/h1-15H;1H3,(H,2,3,4);/q;;+1/p-1
InChIKeyGIKPMOYOPXMJBZ-UHFFFAOYSA-M
XLogP2.60
TPSA57.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500554.36
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

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Related Compounds

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silver;tris(triphenylphosphane);iodide
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triphenylphosphane
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iron dihydride;tetrakis(triphenylphosphane)
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triphenylphosphane;yttrium
CID 139917776
tetrakis(triphenylphosphane);dihydrochloride
CID 172855409
copper monohydride;hexakis(triphenylphosphane)
CID 134992255
silane;triphenylphosphane
CID 161037280
plutonium;triphenylphosphane
CID 161300359
CID 87948921
CID 87948921
triphenylphosphane;octahydrochloride
CID 172751742
tris(triphenylphosphane);hydrobromide
CID 172722268

Frequently Asked Questions

What is the IUPAC name of gold(1+);methanesulfonate;triphenylphosphane?
The IUPAC name of gold(1+);methanesulfonate;triphenylphosphane (CID 172719682) is gold(1+);methanesulfonate;triphenylphosphane.
What is the SMILES notation for gold(1+);methanesulfonate;triphenylphosphane?
The canonical SMILES for gold(1+);methanesulfonate;triphenylphosphane is CS(=O)(=O)[O-].[Au+].c1ccc(P(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of gold(1+);methanesulfonate;triphenylphosphane?
The InChIKey is GIKPMOYOPXMJBZ-UHFFFAOYSA-M. The full InChI is InChI=1S/C18H15P.CH4O3S.Au/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-5(2,3)4;/h1-15H;1H3,(H,2,3,4);/q;;+1/p-1.
What are the key properties of gold(1+);methanesulfonate;triphenylphosphane?
gold(1+);methanesulfonate;triphenylphosphane has a molecular weight of 554.36 g/mol, XLogP of 2.60, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for gold(1+);methanesulfonate;triphenylphosphane is sourced from PubChem (CID 172719682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).